(E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate
TL;DR: (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate (CAS 340029-50-7) is a chemical compound with molecular formula C20H20F3NO4 and molecular weight 395.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3,3,3-trifluoro-2-hydroxy-2-[4-[(4-methoxyphenyl)methylideneamino]-3-methylphenyl]propanoate
Also Known As: (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate, ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-{[(E)-(4-methoxyphenyl)methylidene]amino}-3-methylphenyl)propanoate, ethyl 3,3,3-trifluoro-2-hydroxy-2-[4-[(4-methoxyphenyl)methylideneamino]-3-methylphenyl]propanoate
| Molecular Formula | C20H20F3NO4 |
|---|---|
| Molecular Weight | 395.13 g/mol |
| LogP | 4.06722 |
| Topological Polar Surface Area | 68.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.13443 |
| Heavy Atoms | 28 |
| Complexity | 862.7448 |
Chemical Identifiers
| CAS Number | 340029-50-7 |
|---|---|
| SMILES | CCOC(=O)C(C1=CC(=C(C=C1)N=CC2=CC=C(C=C2)OC)C)(C(F)(F)F)O |
Product Overview
(E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate (CAS 340029-50-7), with molecular formula C20H20F3NO4 and molecular weight 395.13 g/mol. IUPAC: ethyl 3,3,3-trifluoro-2-hydroxy-2-[4-[(4-methoxyphenyl)methylideneamino]-3-methylphenyl]propanoate.
Chemical Property Profile of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate
Property Insights of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate
The XLogP value of 4.06722 indicates that (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.12 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate. Following Lipinski's Rule of Five, (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate?
The CAS number of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate is 340029-50-7.
What is the molecular formula of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate?
The molecular formula of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate is C20H20F3NO4.
What is the molecular weight of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate?
The molecular weight of (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate is 395.13 g/mol.
Where can I buy (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate?
You can request a quote for (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 3,3,3-trifluoro-2-hydroxy-2-(4-((4-methoxybenzylidene)amino)-3-methylphenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.